# CIF generated by HEAS from Alexandria entry agm006403530 data_agm006403530 _cell_length_a 6.53119 _cell_length_b 6.53119 _cell_length_c 6.53119 _cell_angle_alpha 143.61063 _cell_angle_beta 127.91520 _cell_angle_gamma 65.19708 _cell_volume 128.70268 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nd1 Nd 0.00000 0.50000 0.50000 1.00000 Tl1 Tl 0.32218 0.82218 0.50000 1.00000 Tl2 Tl 0.67782 0.17782 0.50000 1.00000 H1 H 0.09171 0.33488 0.75683 1.00000 H2 H 0.42196 0.66512 0.75683 1.00000 H3 H 0.91234 0.91234 0.00000 1.00000 H4 H 0.83425 0.00000 0.83425 1.00000 H5 H 0.08766 0.08766 0.00000 1.00000 H6 H 0.57804 0.33488 0.24317 1.00000 H7 H 0.90829 0.66512 0.24317 1.00000 H8 H 0.16575 0.00000 0.16575 1.00000